SCHEMBL15549708

SCHEMBL15549708

COC12CC3C[C@H](C1)C(Oc1cc(F)c(C(=O)O)cc1Cl)[C@@H](C3)C2

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 0.74
▸ SCN5A Q14524 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15549710 1.00 SCN9A (0.74) SCN9ASCN5A
SCHEMBL16448641 1.00 SCN9A (0.74) SCN9ASCN5A
SCHEMBL16448640 1.00 SCN9A (0.74) SCN9ASCN5A
SCHEMBL15536696 1.00 SCN9A (0.74) SCN9ASCN5A
SCHEMBL16449085 0.87 SCN9A (0.59) SCN9ASCN5A
SCHEMBL15536873 0.85 SCN9A (0.72) SCN9ASCN5A
SCHEMBL16448713 0.85 SCN9A (0.76) SCN9ASCN5A
SCHEMBL15550097 0.85 SCN9A (1.00) SCN9ASCN5A
SCHEMBL15548720 0.85 SCN9A (1.00) SCN9ASCN5A
SCHEMBL15548721 0.85 SCN9A (1.00) SCN9ASCN5A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2855428-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN Genentech, Inc. (US) 2015-04-08 — — EP disclosed
WO-2013177224-A1 N-SUBSTITUTED BENZAMIDES AND THEIR USE IN THE TREATMENT OF PAIN GENENTECH, INC. (US) 2013-11-28 — — WO disclosed
Send feedback